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121014-31-1 | 7H-Isoxazolo[4,5-c]pyrazolo[1,2-a]pyridazine(9CI)
CAS No: 121014-31-1 Catalog No: AG009PT5 MDL No:
Product Description
Catalog Number:
AG009PT5
Chemical Name:
7H-Isoxazolo[4,5-c]pyrazolo[1,2-a]pyridazine(9CI)
CAS Number:
121014-31-1
IUPAC Name:
5-oxa-1,4,9-triazatricyclo[7.3.0.02,6]dodeca-2(6),3,7,11-tetraene
InChI:
InChI=1S/C8H7N3O/c1-3-10-5-2-8-7(6-9-12-8)11(10)4-1/h1-2,4-6H,3H2
InChI Key:
PFUFXUZTLDBXIV-UHFFFAOYSA-N
Properties
Complexity:
251
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
161.059g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
161.164g/mol
Monoisotopic Mass:
161.059g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
32.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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